| SpectraBase Compound ID | LaNfyDhOVd1 |
|---|---|
| InChI | InChI=1S/C19H28O5/c1-12(2)19-17(23-14(4)21)9-13(3)7-6-8-16(11-20)10-18(19)24-15(5)22/h8-9,11-12,17-19H,6-7,10H2,1-5H3/b13-9+,16-8+/t17-,18-,19-/m1/s1 |
| InChIKey | IVPDEPJTXZGQDQ-ISRQIGLJSA-N |
| Mol Weight | 336.43 g/mol |
| Molecular Formula | C19H28O5 |
| Exact Mass | 336.193674 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8XkDw0N87i3 |
|---|---|
| Name | (6R,7S,8R)-6,8-Diacetoxy-7-isopropyl-10-formyl-4-methylcycloundeca-4,10(1)-diene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H28O5 |
| InChI | InChI=1S/C19H28O5/c1-12(2)19-17(23-14(4)21)9-13(3)7-6-8-16(11-20)10-18(19)24-15(5)22/h8-9,11-12,17-19H,6-7,10H2,1-5H3/b13-9+,16-8+/t17-,18-,19-/m1/s1 |
| InChIKey | IVPDEPJTXZGQDQ-ISRQIGLJSA-N |
| Molecular Weight | 336.428 g/mol |
| SMILES | [C@]1([C@]([C@](OC(=O)C)(C\C(C=O)=C/CC\C(=C\1)C)[H])(C(C)C)[H])(OC(=O)C)[H] |
| SPLASH | splash10-0601-2920000000-e15e115e878584af1eea |
| Source of Spectrum | X2-68-529-2 |
| Synonyms | (1R,9R,10S)-9-(acetyloxy)-3-formyl-10-isopropyl-7-methyl-3,7-cyclodecadien-1-yl acetate 6,8-Diacetoxy-7-isopropyl-10-formyl-4-methylcycloundeca-4,10(1)-diene Pulicanadiene B Acetic acid [(1R,3E,7E,9R,10S)-9-acetyloxy-3-formyl-7-methyl-10-propan-2-yl-1-cyclodeca-3,7-dienyl] ester [(1R,3E,7E,9R,10S)-9-acetyloxy-3-formyl-7-methyl-10-propan-2-ylcyclodeca-3,7-dien-1-yl] acetate [(1R,3E,7E,9R,10S)-9-acetoxy-3-formyl-10-isopropyl-7-methyl-cyclodeca-3,7-dien-1-yl] acetate [(1R,3E,7E,9R,10S)-9-acetyloxy-3-methanoyl-7-methyl-10-propan-2-yl-cyclodeca-3,7-dien-1-yl] ethanoate |
| Wiley ID | 1609504 |